| SpectraBase Compound ID | 4FXCmHsqjmp |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3,7-8H,1,4-6,9H2,2H3/b8-7+ |
| InChIKey | FGFBSRAQZIORCU-BQYQJAHWSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FRYiSyGFvVj |
|---|---|
| Name | 3,8-Nonadienoic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3,7-8H,1,4-6,9H2,2H3/b8-7+ |
| InChIKey | FGFBSRAQZIORCU-BQYQJAHWSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C(=O)(C\C=C\CCCC=C)OC |